CID 199091

Pc 614

Structural Information

Molecular Formula
C7H16N2O2
SMILES
CC(C)NNC(=O)CCCO
InChI
InChI=1S/C7H16N2O2/c1-6(2)8-9-7(11)4-3-5-10/h6,8,10H,3-5H2,1-2H3,(H,9,11)
InChIKey
SFCAJVLMRPMFBW-UHFFFAOYSA-N
Compound name
4-hydroxy-N'-propan-2-ylbutanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

160.12119 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.128466 137.9
[M+Na]+ 183.110408 142.3
[M-H]- 159.113914 136.6
[M+NH4]+ 178.155013 157.3
[M+K]+ 199.084348 142.1
[M+H-H2O]+ 143.118450 132.3
[M+HCOO]- 205.119391 160.5
[M+CH3COO]- 219.135041 181.5
[M+Na-2H]- 181.095856 141.6
[M]+ 160.12064142 136.7
[M]- 160.12173858 136.7
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