CID 10535205

N-(prop-2-en-1-yl)(tert-butoxy)carbohydrazide

Structural Information

Molecular Formula
C8H16N2O2
SMILES
CC(C)(C)OC(=O)N(CC=C)N
InChI
InChI=1S/C8H16N2O2/c1-5-6-10(9)7(11)12-8(2,3)4/h5H,1,6,9H2,2-4H3
InChIKey
ZTWGIZOCAXOUOE-UHFFFAOYSA-N
Compound name
tert-butyl N-amino-N-prop-2-enylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

96
Patents

172.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.12847 139.9
[M+Na]+ 195.11041 145.8
[M-H]- 171.11391 141.2
[M+NH4]+ 190.15501 160.3
[M+K]+ 211.08435 146.6
[M+H-H2O]+ 155.11845 134.7
[M+HCOO]- 217.11939 163.4
[M+CH3COO]- 231.13504 187.0
[M+Na-2H]- 193.09586 144.0
[M]+ 172.12064 140.6
[M]- 172.12174 140.6
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