CID 3048066

Hydrazine, 2-benzyl-1-pantoyl-

Structural Information

Molecular Formula
C13H20N2O3
SMILES
CC(C)(CO)[C@H](C(=O)NNCC1=CC=CC=C1)O
InChI
InChI=1S/C13H20N2O3/c1-13(2,9-16)11(17)12(18)15-14-8-10-6-4-3-5-7-10/h3-7,11,14,16-17H,8-9H2,1-2H3,(H,15,18)/t11-/m0/s1
InChIKey
UALJZWVUQPESTK-NSHDSACASA-N
Compound name
(2R)-N'-benzyl-2,4-dihydroxy-3,3-dimethylbutanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.1474 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.15468 159.1
[M+Na]+ 275.13662 162.2
[M-H]- 251.14012 159.4
[M+NH4]+ 270.18122 173.8
[M+K]+ 291.11056 160.1
[M+H-H2O]+ 235.14466 152.6
[M+HCOO]- 297.14560 178.6
[M+CH3COO]- 311.16125 195.1
[M+Na-2H]- 273.12207 163.2
[M]+ 252.14685 156.9
[M]- 252.14795 156.9
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