CID 9948555

Tert-butyl 2-((2s,3s)-2-(benzyloxy)pentan-3-yl)hydrazinecarboxylate

Structural Information

Molecular Formula
C17H28N2O3
SMILES
CC[C@@H]([C@H](C)OCC1=CC=CC=C1)NNC(=O)OC(C)(C)C
InChI
InChI=1S/C17H28N2O3/c1-6-15(18-19-16(20)22-17(3,4)5)13(2)21-12-14-10-8-7-9-11-14/h7-11,13,15,18H,6,12H2,1-5H3,(H,19,20)/t13-,15-/m0/s1
InChIKey
IJLZRIHVBSTUSD-ZFWWWQNUSA-N
Compound name
tert-butyl N-[[(2S,3S)-2-phenylmethoxypentan-3-yl]amino]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

308.21 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.217276 177.8
[M+Na]+ 331.199218 179.9
[M-H]- 307.202724 180.3
[M+NH4]+ 326.243823 191.8
[M+K]+ 347.173158 179.2
[M+H-H2O]+ 291.207260 170.3
[M+HCOO]- 353.208201 198.1
[M+CH3COO]- 367.223851 211.5
[M+Na-2H]- 329.184666 179.5
[M]+ 308.20945142 180.0
[M]- 308.21054858 180.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe