CID 43200420

[(furan-2-yl)methyl](2-methylbutyl)amine hydrochloride

Structural Information

Molecular Formula
C10H17NO
SMILES
CCC(C)CNCC1=CC=CO1
InChI
InChI=1S/C10H17NO/c1-3-9(2)7-11-8-10-5-4-6-12-10/h4-6,9,11H,3,7-8H2,1-2H3
InChIKey
HXJPXIFVFIFERZ-UHFFFAOYSA-N
Compound name
N-(furan-2-ylmethyl)-2-methylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.13101 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.138286 139.7
[M+Na]+ 190.120228 145.4
[M-H]- 166.123734 143.5
[M+NH4]+ 185.164833 160.3
[M+K]+ 206.094168 145.3
[M+H-H2O]+ 150.128270 133.7
[M+HCOO]- 212.129211 163.9
[M+CH3COO]- 226.144861 182.0
[M+Na-2H]- 188.105676 145.0
[M]+ 167.13046142 141.2
[M]- 167.13155858 141.2
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.