CID 3041914

58774-90-6

Structural Information

Molecular Formula
C12H17NO
SMILES
CC1(C(C2=CC=CC=C2O1)N(C)C)C
InChI
InChI=1S/C12H17NO/c1-12(2)11(13(3)4)9-7-5-6-8-10(9)14-12/h5-8,11H,1-4H3
InChIKey
KLJZWXAEYRTQHC-UHFFFAOYSA-N
Compound name
N,N,2,2-tetramethyl-3H-1-benzofuran-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.13101 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.138286 141.4
[M+Na]+ 214.120228 150.1
[M-H]- 190.123734 148.4
[M+NH4]+ 209.164833 165.5
[M+K]+ 230.094168 149.9
[M+H-H2O]+ 174.128270 136.4
[M+HCOO]- 236.129211 165.0
[M+CH3COO]- 250.144861 190.2
[M+Na-2H]- 212.105676 148.0
[M]+ 191.13046142 144.1
[M]- 191.13155858 144.1
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.