CID 14752303

Tert-butyl n-[(1s)-1-(hydrazinecarbonyl)-2-hydroxyethyl]carbamate

Structural Information

Molecular Formula
C8H17N3O4
SMILES
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NN
InChI
InChI=1S/C8H17N3O4/c1-8(2,3)15-7(14)10-5(4-12)6(13)11-9/h5,12H,4,9H2,1-3H3,(H,10,14)(H,11,13)/t5-/m0/s1
InChIKey
PWWLFQFIVAGVEV-YFKPBYRVSA-N
Compound name
tert-butyl N-[(2S)-1-hydrazinyl-3-hydroxy-1-oxopropan-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

219.1219 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.12918 149.7
[M+Na]+ 242.11112 153.3
[M-H]- 218.11462 148.0
[M+NH4]+ 237.15572 166.1
[M+K]+ 258.08506 154.2
[M+H-H2O]+ 202.11916 143.8
[M+HCOO]- 264.12010 170.5
[M+CH3COO]- 278.13575 192.0
[M+Na-2H]- 240.09657 151.9
[M]+ 219.12135 147.7
[M]- 219.12245 147.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe