CID 156620437

743372-50-1

Structural Information

Molecular Formula
C8H17N3O
SMILES
CC(C)CN1CCN(CC1)N=O
InChI
InChI=1S/C8H17N3O/c1-8(2)7-10-3-5-11(9-12)6-4-10/h8H,3-7H2,1-2H3
InChIKey
WHNXFFIKKJESQD-UHFFFAOYSA-N
Compound name
1-(2-methylpropyl)-4-nitrosopiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.13716 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.14444 139.4
[M+Na]+ 194.12638 144.6
[M-H]- 170.12988 140.8
[M+NH4]+ 189.17098 157.3
[M+K]+ 210.10032 144.7
[M+H-H2O]+ 154.13442 131.5
[M+HCOO]- 216.13536 159.2
[M+CH3COO]- 230.15101 185.4
[M+Na-2H]- 192.11183 144.0
[M]+ 171.13661 137.3
[M]- 171.13771 137.3
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

No patent data available for this compound.