CID 263171

5064-46-0

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)NCC1CCCO1
InChI
InChI=1S/C8H17NO/c1-7(2)9-6-8-4-3-5-10-8/h7-9H,3-6H2,1-2H3
InChIKey
PELLLKANMONICH-UHFFFAOYSA-N
Compound name
N-(oxolan-2-ylmethyl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

146
Patents

143.13101 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 134.1
[M+Na]+ 166.120228 138.6
[M-H]- 142.123734 137.5
[M+NH4]+ 161.164833 155.5
[M+K]+ 182.094168 139.4
[M+H-H2O]+ 126.128270 128.5
[M+HCOO]- 188.129211 156.0
[M+CH3COO]- 202.144861 176.7
[M+Na-2H]- 164.105676 138.5
[M]+ 143.13046142 132.0
[M]- 143.13155858 132.0
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