CID 214966

34694-91-2

Structural Information

Molecular Formula
C8H17N3O
SMILES
C1CC(OC1)CCCN=C(N)N
InChI
InChI=1S/C8H17N3O/c9-8(10)11-5-1-3-7-4-2-6-12-7/h7H,1-6H2,(H4,9,10,11)
InChIKey
RULVDGROGOLQOM-UHFFFAOYSA-N
Compound name
2-[3-(oxolan-2-yl)propyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.13716 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.14444 140.0
[M+Na]+ 194.12638 143.4
[M-H]- 170.12988 143.6
[M+NH4]+ 189.17098 159.5
[M+K]+ 210.10032 143.6
[M+H-H2O]+ 154.13442 132.9
[M+HCOO]- 216.13536 164.2
[M+CH3COO]- 230.15101 186.5
[M+Na-2H]- 192.11183 143.4
[M]+ 171.13661 135.3
[M]- 171.13771 135.3
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.