CID 43149664

2-methyl-1-(3-methyl-1-benzofuran-2-yl)propan-1-amine

Structural Information

Molecular Formula
C13H17NO
SMILES
CC1=C(OC2=CC=CC=C12)C(C(C)C)N
InChI
InChI=1S/C13H17NO/c1-8(2)12(14)13-9(3)10-6-4-5-7-11(10)15-13/h4-8,12H,14H2,1-3H3
InChIKey
HVLPOBQRKWXUAB-UHFFFAOYSA-N
Compound name
2-methyl-1-(3-methyl-1-benzofuran-2-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

203.13101 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.13829 145.4
[M+Na]+ 226.12023 157.8
[M+NH4]+ 221.16483 154.5
[M+K]+ 242.09417 153.8
[M-H]- 202.12373 149.7
[M+Na-2H]- 224.10568 150.7
[M]+ 203.13046 148.4
[M]- 203.13156 148.4
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

patents stripe